3,3-dimethyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: 3,3-dimethyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: 3,3-dimethyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one CAS Name: 3,3-dimethyl-1-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: 3,3-dimethyl-1-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: 1-(4-mesitylsulfonylpiperazino)-3,3-dimethyl-butan-1-one Formula: C19H30N2O3S MolecularWeight: 366.5181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CC(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CC(C)(C)C)C

InChI

InChI=1S/C19H30N2O3S/c1-14-11-15(2)18(16(3)12-14)25(23,24)21-9-7-20(8-10-21)17(22)13-19(4,5)6/h11-12H,7-10,13H2,1-6H3